ethyl 2-(4-oxidanylidene-3-phenyl-7-pyrrolidin-1-ylcarbonyl-quinazolin-2-yl)sulfanylethanoate

Systemtic Name: ethyl 2-(4-oxidanylidene-3-phenyl-7-pyrrolidin-1-ylcarbonyl-quinazolin-2-yl)sulfanylethanoate Openeye Name: ethyl 2-[4-oxo-3-phenyl-7-(pyrrolidine-1-carbonyl)quinazolin-2-yl]sulfanylacetate CAS Name: 2-[[4-oxo-7-[oxo(1-pyrrolidinyl)methyl]-3-phenyl-2-quinazolinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-oxo-3-phenyl-7-(pyrrolidine-1-carbonyl)quinazolin-2-yl]sulfanylacetate Traditional Name: 2-[[4-keto-3-phenyl-7-(pyrrolidine-1-carbonyl)quinazolin-2-yl]thio]acetic acid ethyl ester Formula: C23H23N3O4S MolecularWeight: 437.51142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC2=C(C=CC(=C2)C(=O)N3CCCC3)C(=O)N1C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)CSC1=NC2=C(C=CC(=C2)C(=O)N3CCCC3)C(=O)N1C4=CC=CC=C4

InChI

InChI=1S/C23H23N3O4S/c1-2-30-20(27)15-31-23-24-19-14-16(21(28)25-12-6-7-13-25)10-11-18(19)22(29)26(23)17-8-4-3-5-9-17/h3-5,8-11,14H,2,6-7,12-13,15H2,1H3